[2-[4-(4-fluorophenyl)-5-[2-(3-imidazolidin-1-ylpropylamino)pyrimidin-4-yl]-1H-imidazol-2-yl]-5-methyl-1,3-dioxan-5-yl]-morpholin-4-yl-methanone

Systemtic Name: [2-[4-(4-fluorophenyl)-5-[2-(3-imidazolidin-1-ylpropylamino)pyrimidin-4-yl]-1H-imidazol-2-yl]-5-methyl-1,3-dioxan-5-yl]-morpholin-4-yl-methanone Openeye Name: [2-[4-(4-fluorophenyl)-5-[2-(3-imidazolidin-1-ylpropylamino)pyrimidin-4-yl]-1H-imidazol-2-yl]-5-methyl-1,3-dioxan-5-yl]-morpholino-methanone CAS Name: [2-[4-(4-fluorophenyl)-5-[2-[3-(1-imidazolidinyl)propylamino]-4-pyrimidinyl]-1H-imidazol-2-yl]-5-methyl-1,3-dioxan-5-yl]-(4-morpholinyl)methanone IUPAC Name: [2-[4-(4-fluorophenyl)-5-[2-(3-imidazolidin-1-ylpropylamino)pyrimidin-4-yl]-1H-imidazol-2-yl]-5-methyl-1,3-dioxan-5-yl]-morpholin-4-ylmethanone Traditional Name: [2-[4-(4-fluorophenyl)-5-[2-(3-imidazolidin-1-ylpropylamino)pyrimidin-4-yl]-1H-imidazol-2-yl]-5-methyl-1,3-dioxan-5-yl]-morpholino-methanone Formula: C29H37FN8O4 MolecularWeight: 580.653683

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C2=NC(=C(N2)C3=NC(=NC=C3)NCCCN4CCNC4)C5=CC=C(C=C5)F)C(=O)N6CCOCC6

Isomeric SMILES

CC1(COC(OC1)C2=NC(=C(N2)C3=NC(=NC=C3)NCCCN4CCNC4)C5=CC=C(C=C5)F)C(=O)N6CCOCC6

InChI

InChI=1S/C29H37FN8O4/c1-29(27(39)38-13-15-40-16-14-38)17-41-26(42-18-29)25-35-23(20-3-5-21(30)6-4-20)24(36-25)22-7-9-33-28(34-22)32-8-2-11-37-12-10-31-19-37/h3-7,9,26,31H,2,8,10-19H2,1H3,(H,35,36)(H,32,33,34)